but-2-ynoxybenzene; N-oxidanyl-1-[2-[(phenylmethyl)amino]ethanoyl]-4-(sulfonylmethyl)piperidine-4-carboxamide

Systemtic Name: but-2-ynoxybenzene; N-oxidanyl-1-[2-[(phenylmethyl)amino]ethanoyl]-4-(sulfonylmethyl)piperidine-4-carboxamide Openeye Name: 1-[2-(benzylamino)acetyl]-4-(sulfonylmethyl)piperidine-4-carbohydroxamic acid; but-2-ynoxybenzene CAS Name: but-2-ynoxybenzene; N-hydroxy-1-[1-oxo-2-[(phenylmethyl)amino]ethyl]-4-(sulfonylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(benzylamino)acetyl]-N-hydroxy-4-(sulfonylmethyl)piperidine-4-carboxamide; but-2-ynoxybenzene Traditional Name: 1-[2-(benzylamino)acetyl]-4-(sulfonylmethyl)piperidine-4-carbohydroxamic acid; but-2-ynoxybenzene Formula: C26H31N3O6S MolecularWeight: 513.60584

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=CC=C1.C1CN(CCC1(C=S(=O)=O)C(=O)NO)C(=O)CNCC2=CC=CC=C2

Isomeric SMILES

CC#CCOC1=CC=CC=C1.C1CN(CCC1(C=S(=O)=O)C(=O)NO)C(=O)CNCC2=CC=CC=C2

InChI

InChI=1S/C16H21N3O5S.C10H10O/c20-14(11-17-10-13-4-2-1-3-5-13)19-8-6-16(7-9-19,12-25(23)24)15(21)18-22;1-2-3-9-11-10-7-5-4-6-8-10/h1-5,12,17,22H,6-11H2,(H,18,21);4-8H,9H2,1H3